RDKit 3D 155161 0 0 0 0 0 0 0 0999 V2000 8.9077 1.3230 3.8794 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6445 1.3574 3.1052 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5676 0.9347 3.6502 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5433 1.8216 1.8129 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3417 1.8397 1.1192 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5268 2.9490 1.1576 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3307 2.9907 0.4757 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5118 4.1085 0.5129 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2352 4.6005 1.8019 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3814 5.7905 2.0428 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7215 4.0249 2.8015 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9297 1.9139 -0.2615 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7535 0.7993 -0.2955 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9784 0.7345 0.3923 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 -0.2534 -1.0561 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9026 -0.5255 -1.0926 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7640 -1.7893 -1.8053 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4798 -2.8683 -1.2586 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4774 -4.1258 -1.7819 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2184 -5.1560 -1.1777 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5111 -5.4751 -1.5054 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2328 -6.5928 -0.8157 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0556 -4.7890 -2.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7309 -4.3646 -2.9172 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7134 -5.6409 -3.4671 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -6.5050 -3.1297 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6595 -7.8754 -3.6937 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8214 -6.1086 -2.3136 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0078 -3.3556 -3.5052 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2558 -3.5890 -4.6465 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9145 -3.4918 -5.8639 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1843 -3.7264 -7.1464 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1429 -3.2059 -5.9662 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0556 -2.0904 -2.9151 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9908 0.5775 -1.2388 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2048 0.7322 -2.3895 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 0.7260 -2.4218 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8451 0.9067 -3.7255 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7075 0.5646 -1.3161 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6949 1.9043 -1.0621 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8277 3.0632 -0.9524 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 4.1100 -1.8481 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8539 4.1492 -2.8942 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9434 4.9956 -2.8978 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9323 5.0239 -4.0341 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1607 5.7836 -1.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1033 5.2336 -1.7796 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1498 5.3311 -0.8056 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6563 6.4509 -0.7571 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8859 6.5781 -1.3588 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6126 7.8619 -1.2018 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3473 5.6316 -2.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0451 4.2735 0.0999 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8525 3.1807 0.0306 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7636 2.1304 0.9183 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0587 2.3221 2.0543 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2653 1.1396 2.8735 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 1.2425 4.2491 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3704 0.1765 5.0785 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3004 0.3175 6.4647 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4852 0.6309 7.1069 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 0.8024 8.5883 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5781 0.7823 6.4771 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6102 -1.0605 4.5457 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7759 -2.1382 5.4342 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3612 -2.8215 5.8154 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2957 -3.9870 6.7645 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4724 -2.4447 5.3474 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6766 -1.1938 3.1878 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9205 -2.4541 2.6552 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 -2.9048 2.4009 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5153 -4.2414 1.8335 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1478 -2.1100 2.6764 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5071 -0.1084 2.3447 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3341 3.0514 1.7091 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1963 2.3891 0.8521 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4624 1.9985 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7854 2.2462 2.5063 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4127 1.3195 0.4654 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1493 1.1040 -0.8675 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0666 0.4293 -1.6732 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7926 0.2234 -2.9964 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1201 -0.8923 -3.4398 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8359 -1.0854 -4.8906 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7257 -1.7797 -2.6394 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2623 -0.0360 -1.1405 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1492 -0.7004 -1.9657 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1328 -0.0653 -2.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0082 -0.9260 -3.5581 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2402 1.1703 -2.6379 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5352 0.1742 0.1891 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7114 -0.2669 0.7787 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7243 -1.5263 1.3501 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9486 -2.0933 2.0167 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6543 -2.2009 1.2959 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5954 0.8559 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9927 4.4095 1.1276 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5626 2.1409 3.5828 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4534 0.3581 3.6731 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6473 1.2952 4.9494 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7877 3.8331 1.7222 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9311 6.4433 2.7555 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4622 5.4832 2.5783 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0884 6.3158 1.1249 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5409 -0.1626 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7314 -0.8926 0.0029 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0881 -2.7243 -0.3542 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6098 -6.3198 0.1759 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4629 -7.3982 -0.7082 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9832 -6.9796 -1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1699 -8.5325 -2.9687 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5789 -8.1271 -3.8219 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1721 -7.8575 -4.6771 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7077 -4.4602 -7.8028 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1348 -2.7819 -7.7272 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1385 -4.0137 -6.9132 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5049 -1.3125 -3.3782 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1844 0.4558 -0.4422 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1283 -0.0696 -4.1764 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8294 1.4137 -3.4884 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2471 1.5178 -4.4307 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1224 2.0103 -2.1341 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5720 5.8558 -4.6945 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9922 4.0682 -4.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9346 5.3293 -3.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 6.0341 -2.4899 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3314 8.3155 -0.2285 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6846 7.6531 -1.1588 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3641 8.5888 -1.9854 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5175 3.0716 2.6931 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0114 2.2100 4.7389 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9519 -0.0703 9.0736 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4879 0.9974 8.9768 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1251 1.7234 8.7666 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2925 -4.0939 7.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0339 -4.8901 6.2028 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5025 -3.7018 7.4982 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4662 -4.5965 2.3005 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7546 -5.0133 2.0733 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6608 -4.2122 0.7289 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5709 -0.2756 1.2664 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8383 3.2238 2.6805 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2486 1.4407 -1.3505 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7832 -1.1941 -5.4519 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3333 -0.1604 -5.2668 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1557 -1.9280 -5.0299 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9484 -0.4138 -3.8639 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4370 -1.1230 -4.5031 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2139 -1.8606 -3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7704 -2.2575 1.3067 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6402 -3.0857 2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1977 -1.3947 2.8438 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8640 0.9945 2.0354 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7876 5.1847 1.8571 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9253 4.7415 0.5738 H 0 0 0 0 0 0 0 0 0 0 0 0 38 37 1 0 37 39 2 0 37 36 1 0 36 35 1 0 35 16 1 0 16 15 1 0 15 13 1 0 13 14 2 0 14 5 1 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 2 0 7 12 2 0 12 40 1 0 40 41 1 0 41 42 2 0 42 43 1 0 43 44 1 0 44 45 1 0 44 46 2 0 42 47 1 0 47 48 2 0 48 49 1 0 49 50 1 0 50 51 1 0 50 52 2 0 48 53 1 0 53 54 2 0 54 55 1 0 55 56 1 0 56 75 1 0 75 97 1 0 75 76 1 0 76 77 1 0 77 78 2 0 77 79 1 0 79 80 2 0 80 81 1 0 81 82 1 0 82 83 1 0 83 84 1 0 83 85 2 0 81 86 2 0 86 87 1 0 87 88 1 0 88 89 1 0 88 90 2 0 86 91 1 0 91 92 1 0 92 93 1 0 93 94 1 0 93 95 2 0 91 96 2 0 56 57 1 0 57 58 2 0 58 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 61 63 2 0 59 64 2 0 64 65 1 0 65 66 1 0 66 67 1 0 66 68 2 0 64 69 1 0 69 70 1 0 70 71 1 0 71 72 1 0 71 73 2 0 69 74 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 21 23 2 0 19 24 2 0 24 25 1 0 25 26 1 0 26 27 1 0 26 28 2 0 24 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 31 33 2 0 29 34 2 0 40 35 1 0 54 41 1 0 96 79 1 0 74 57 1 0 34 17 1 0 12 13 1 0 97 53 1 0 38119 1 0 38120 1 0 38121 1 0 35118 1 1 16106 1 1 14105 1 0 1 98 1 0 1 99 1 0 1100 1 0 6101 1 0 10102 1 0 10103 1 0 10104 1 0 40122 1 6 45123 1 0 45124 1 0 45125 1 0 47126 1 0 51127 1 0 51128 1 0 51129 1 0 56130 1 1 75142 1 1 97154 1 0 97155 1 0 80143 1 0 84144 1 0 84145 1 0 84146 1 0 89147 1 0 89148 1 0 89149 1 0 94150 1 0 94151 1 0 94152 1 0 96153 1 0 58131 1 0 62132 1 0 62133 1 0 62134 1 0 67135 1 0 67136 1 0 67137 1 0 72138 1 0 72139 1 0 72140 1 0 74141 1 0 18107 1 0 22108 1 0 22109 1 0 22110 1 0 27111 1 0 27112 1 0 27113 1 0 32114 1 0 32115 1 0 32116 1 0 34117 1 0 M END